SCHEMBL20848892

SCHEMBL20848892

Cc1cccc(-c2ccc3c(c2)c2cc(-c4cccc(C)c4)ccc2n3-c2ccc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)c(-c3cc(C#N)ccc3-n3c4ccc(-c5cccc(C)c5)cc4c4cc(-c5cccc(C)c5)ccc43)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.40
ELANE P08246 11/20 0.34
CYP2C9 P11712 2/20 0.34
SCN9A Q15858 1/20 0.34
ICMT O60725 1/20 0.33
MAT2A P31153 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
KIF11 P52732 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
PTPN5 P54829 1/20 0.31
CYP3A4 P08684 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20848891 0.97 AR (0.38) ARELANECYP2C9SCN9AICMT
SCHEMBL22985056 0.95 AR (0.43) ARELANECYP2C9ICMTKIF11
SCHEMBL20848772 0.93 ELANE (0.32) ARELANEPTGDR2KIF11
SCHEMBL20848950 0.93 PTPN5 (0.36) ELANECYP2C9SCN9AMAT2APTGDR2
SCHEMBL22985580 0.92 AR (0.40) ARELANE
SCHEMBL20848952 0.91 CYP2C9 (0.33) ARELANECYP2C9SCN9APTGDR2
SCHEMBL20849191 0.91 KIF11 (0.35) ARELANECYP2C9SCN9APTGDR2
SCHEMBL20848475 0.91 AR (0.42) ARELANECYP2C9SCN9AICMT
SCHEMBL20848742 0.90 AR (0.43) ARELANECYP2C9SCN9AICMT
SCHEMBL20848873 0.90 ELANE (0.34) ARELANEPTGDR2KIF11

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10978646-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-13 US disclosed
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10978646-B2 Organic molecules for use in optoelectronic devices OCIAD2, OCIAD1, POU2F1 AR 3706/4885ELANE 4164/4885CYP2C9 725/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885ELANE 4164/4885CYP2C9 725/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.